SCHEMBL6558138

SCHEMBL6558138

CCOC(Cn1c(-c2ccc(OC)cc2)ncc(C(=O)O)c1=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 6/20 0.40
GAA P10253 1/20 0.40
PPARG P37231 1/20 0.40
LMNA P02545 2/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2B Q13224 1/20 0.39
PPARD Q03181 1/20 0.38
TARBP2 Q15633 1/20 0.38
PDCD4 Q53EL6 1/20 0.38
HTT P42858 1/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
RECQL P46063 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6558325 0.90 KDM4E (0.49) KDM4EMEN1KMT2AALDH1A1GAA
SCHEMBL6556282 0.90 KDM4E (0.38) KDM4EMEN1KMT2AALDH1A1GAA
SCHEMBL6556361 0.89 MAPT (0.42) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL6557511 0.88 P2RX3 (0.41) KDM4EKMT2AALDH1A1PPARGLMNA
SCHEMBL6556234 0.88 ELANE (0.39) KDM4EALDH1A1GAAPPARDELANE
SCHEMBL6556504 0.87 CSNK1D (0.37) KDM4EMEN1KMT2AALDH1A1GAA
SCHEMBL6558245 0.84 MAPT (0.40) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL6557546 0.83 CTRC (0.42) KDM4EMEN1KMT2AALDH1A1GAA
SCHEMBL6558315 0.82 MEN1 (0.42) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL7152432 0.80 MAPT (0.41) KDM4EMEN1KMT2AALDH1A1PPARG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0826671-B1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
US-5948785-A USEFUL AS CHYMASE INHIBITORS AND CAN BE EFFECTIVE FOR THE PROPHYLAXIS AND TREATMENT OF VARIOUS DISEASES CAUSED BY CHYMASE, SUCH AS THOSE CAUSED BY ANGIOTENSIN II. THE GREEN CROSS CORPORATION (JP) 1999-09-07 US disclosed
EP-0826671-A1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME THE GREEN CROSS CORPORATION (JP) 1998-03-04 EP disclosed